Known targets — ChEMBL curated mechanism
BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27761315 | 0.83 | CYP1A2 (0.61) | TSHRCYP1A2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL29354784 | 0.83 | CYP1A2 (0.61) | TSHRCYP1A2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL29613838 | 0.83 | CYP1A2 (0.61) | TSHRCYP1A2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL29250333 | 0.83 | CYP1A2 (0.61) | TSHRCYP1A2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL28479066 | 0.83 | CYP1A2 (0.61) | TSHRCYP1A2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL28479069 | 0.83 | CYP1A2 (0.61) | TSHRCYP1A2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL9869468 | 0.83 | CYP1A2 (0.61) | TSHRCYP1A2ALDH1A1HSD17B10KDM4E | |
| Hydrochloric Acid SCHEMBL28505130 | 0.82 | CYP1A2 (0.58) | TSHRCYP1A2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL29613831 | 0.82 | CYP1A2 (0.58) | TSHRCYP1A2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL27725318 | 0.80 | TSHR (0.59) | TSHRSMN1; SMN2ALDH1A1HSD17B10KDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210323829-A1 | PRODUCTION OF GRAPHITIC FILMS FROM A MIXTURE OF GRAPHENE OXIDE AND HIGHLY AROMATIC MOLECULES | GLOBAL GRAPHENE GROUP, INC. | 2021-10-21 | — | — | US | claimed |
| US-20210323829-A1 | PRODUCTION OF GRAPHITIC FILMS FROM A MIXTURE OF GRAPHENE OXIDE AND HIGHLY AROMATIC MOLECULES | GLOBAL GRAPHENE GROUP, INC. | 2021-10-21 | — | — | US | disclosed |